A numerical study of one-step models of polymerization: frontal versus bulk mode (Q2566692)

A one-dimensional process of conversion of monomer to polymer is considered with the aim of comparing three different models able to describe the propagation of a self-sustaining reaction front. The basic model is based on Arrhenius law. A first modification consists in multiplying the Arrhenius kinetics by a cutoff function which eliminates the bulk reaction ahead of the advancing front. The third model considers just a step function kinetics. The validity of each of the two modified models depends on the values of the main physical parameters. Through a series of numerical simulations the authors point out several conclusions of physical relevance.